CID 3053637

70203-76-8

Structural Information

Molecular Formula
C20H21N3O2
SMILES
CC(C)CC(C(=O)N)N1C(=NC2=CC=CC=C2C1=O)C3=CC=CC=C3
InChI
InChI=1S/C20H21N3O2/c1-13(2)12-17(18(21)24)23-19(14-8-4-3-5-9-14)22-16-11-7-6-10-15(16)20(23)25/h3-11,13,17H,12H2,1-2H3,(H2,21,24)
InChIKey
BXFGJVDMHTZGIA-UHFFFAOYSA-N
Compound name
4-methyl-2-(4-oxo-2-phenylquinazolin-3-yl)pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.1634 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.17068 179.6
[M+Na]+ 358.15262 193.4
[M+NH4]+ 353.19722 186.1
[M+K]+ 374.12656 186.8
[M-H]- 334.15612 183.2
[M+Na-2H]- 356.13807 186.7
[M]+ 335.16285 182.5
[M]- 335.16395 182.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.